⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL963635 | 0.73 | — | — | |
| SCHEMBL201118 | 0.66 | — | — | |
| SCHEMBL14084958 | 0.64 | — | — | |
| SCHEMBL963323 | 0.61 | — | — | |
| SCHEMBL1338493 | 0.60 | — | — | |
| SCHEMBL20337187 | 0.56 | — | — | |
| SCHEMBL2378358 | 0.52 | — | — | |
| SCHEMBL18343604 | 0.52 | — | — | |
| SCHEMBL4622147 | 0.50 | — | — | |
| SCHEMBL24055070 | 0.49 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10273215-B2 | Process for preparing substituted pyrazoles containing haloalkoxy- and haloalkylthio groups from alpha,alpha -dihaloalkylamines and ketimines | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2019-04-30 | — | — | US | disclosed |
| US-20180186749-A1 | PROCESS FOR PREPARING SUBSTITUTED PYRAZOLES CONTAINING HALOALKOXY- AND HALOALKYLTHIO GROUPS FROM alpha,alpha -DIHALOALKYLAMINES AND KETIMINES | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2018-07-05 | — | — | US | disclosed |